SCHEMBL19101792

SCHEMBL19101792

C/N=C\[C@]1(CO)O[C@@H](c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.46
▸ DOT1L Q8TEK3 3/20 0.34
▸ STING1 Q86WV6 1/20 0.30
▸ MAP4K4 O95819 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16698694 0.86 POLRMT (0.46) POLRMTDOT1LSTING1MAP4K4
SCHEMBL26295326 0.84 POLRMT (0.36) POLRMT
SCHEMBL16708561 0.81 POLRMT (0.48) POLRMTDOT1LSTING1MAP4K4
SCHEMBL25821425 0.78 POLRMT (0.48) POLRMTDOT1LSTING1MAP4K4
SCHEMBL23827983 0.77 POLRMT (0.47) POLRMTDOT1LSTING1MAP4K4
SCHEMBL16699508 0.77 POLRMT (0.47) POLRMTDOT1LSTING1MAP4K4
SCHEMBL20960033 0.77 POLRMT (0.45) POLRMTDOT1LSTING1MAP4K4
SCHEMBL16708513 0.76 POLRMT (0.39) POLRMTDOT1LMAP4K4
SCHEMBL23959972 0.76 POLRMT (0.48) POLRMTDOT1LSTING1MAP4K4
SCHEMBL19779087 0.76 POLRMT (0.46) POLRMTDOT1LSTING1MAP4K4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9701682-B2 Pyrrolo[1,2-f][1,2,4]triazines useful for treating respiratory syncitial virus infections GILEAD SCIENCES, INC. (US) 2017-07-11 — — US disclosed
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